Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM50476
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM50476 |
| SMILES |
C#CC(O)C(=O)CCF
|
| InChIKey |
WBTKHQWSLYQPJE-UHFFFAOYSA-N
|
| MW [Da] |
130.12
Automatically obtained from RDkit software. |
| LogP |
-0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM351452
Similarity: 0.7123
Similarity to MM351452
| Tanimoto metric | 0.7123 |
|---|---|
| Cosine metric | 0.844 |
| Dice metric | 0.832 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108344
Similarity: 0.6538
Similarity to MM108344
| Tanimoto metric | 0.6538 |
|---|---|
| Cosine metric | 0.8086 |
| Dice metric | 0.7907 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173215
Similarity: 0.6508
Similarity to MM173215
| Tanimoto metric | 0.6508 |
|---|---|
| Cosine metric | 0.7885 |
| Dice metric | 0.7885 |
| MW: | 130.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+156 more
